2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan

C24H22O3 — CID 57262426

IUPAC2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan
SMILESc1ccc(Cc2cc(COCc3coc(Cc4ccccc4)c3)co2)cc1
InChIInChI=1S/C24H22O3/c1-3-7-19(8-4-1)11-23-13-21(17-26-23)15-25-16-22-14-24(27-18-22)12-20-9-5-2-6-10-20/h1-10,13-14,17-18H,11-12,15-16H2
InChIKeyYPNXTFYJXVCQIP-UHFFFAOYSA-N
MW358.44 g/mol
LogP5.77
Rot. Bonds8

About 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan

2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan (PubChem CID 57262426) has the molecular formula C24H22O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan.

Molecular Properties

Compound Name2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan
PubChem CID57262426
Molecular FormulaC24H22O3
Molecular Weight358.44 g/mol
Exact Mass358.16
IUPAC Name2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan
SMILESc1ccc(Cc2cc(COCc3coc(Cc4ccccc4)c3)co2)cc1
InChIInChI=1S/C24H22O3/c1-3-7-19(8-4-1)11-23-13-21(17-26-23)15-25-16-22-14-24(27-18-22)12-20-9-5-2-6-10-20/h1-10,13-14,17-18H,11-12,15-16H2
InChIKeyYPNXTFYJXVCQIP-UHFFFAOYSA-N
XLogP5.77
TPSA35.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-benzylfuran-3-yl)ethanol
CID 67742011
(5-benzylfuran-3-yl)methyl 2-(4-chlorophenyl)-2-cyclopropylacetate
CID 12604000
CID 66734377
CID 66734377
trans-(5-benzylfuran-3-yl)methyl (1R,3R)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
CID 54142900
N-methylmethanamine;phenylmethoxymethylbenzene
CID 70181699
2-benzyl-4-[(3-benzyl-4-fluorophenyl)methoxymethyl]-1-fluorobenzene
CID 57234743
ethane;phenylmethoxymethylbenzene
CID 90943549
(5-benzylfuran-3-yl)methyl 3-[(E)-2-cyclopentylethenyl]-2,2-dimethylcyclopropane-1-carboxylate
CID 23447064
methyl 6-benzyl-4-oxopyran-3-carboxylate
CID 54671421
5-(phenylmethoxymethyl)furan-3-carbohydrazide
CID 55213199
dichloromethane;phenylmethoxymethylbenzene
CID 174530379
2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
CID 102127806

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan?
The IUPAC name of 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan (CID 57262426) is 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan.
What is the SMILES notation for 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan?
The canonical SMILES for 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan is c1ccc(Cc2cc(COCc3coc(Cc4ccccc4)c3)co2)cc1.
What is the InChIKey of 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan?
The InChIKey is YPNXTFYJXVCQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O3/c1-3-7-19(8-4-1)11-23-13-21(17-26-23)15-25-16-22-14-24(27-18-22)12-20-9-5-2-6-10-20/h1-10,13-14,17-18H,11-12,15-16H2.
What are the key properties of 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan?
2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan has a molecular weight of 358.44 g/mol, XLogP of 5.77, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-4-[(5-benzylfuran-3-yl)methoxymethyl]furan is sourced from PubChem (CID 57262426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).